SCHEMBL4358315

SCHEMBL4358315

CCCCN(CCO)c1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.43
ERBB2 P04626 1/20 0.43
CNR2 P34972 2/20 0.42
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP2C19 P33261 1/20 0.39
NR1H2 P55055 4/20 0.39
NR1H3 Q13133 4/20 0.39
MAPT P10636 4/20 0.38
TP53 P04637 1/20 0.38
GAA P10253 2/20 0.38
POLB P06746 1/20 0.38
KCNH2 Q12809 1/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
PSMD14 O00487 1/20 0.37
NPC1 O15118 1/20 0.37
MITF O75030 1/20 0.37
RAB9A P51151 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25913652 0.91 CNR2 (0.44) EGFRERBB2CNR2ALDH1A1KDM4E
SCHEMBL627242 0.90 CYP2C19 (0.45) EGFRERBB2CNR2ALDH1A1KDM4E
SCHEMBL903672 0.89 CYP2C19 (0.41) EGFRERBB2CNR2ALDH1A1KDM4E
SCHEMBL21065748 0.88 CYP2C19 (0.44) EGFRERBB2CNR2ALDH1A1KDM4E
Lithium Ion SCHEMBL19732617 0.88 CYP2C19 (0.44) EGFRERBB2CNR2ALDH1A1KDM4E
SCHEMBL33921 0.88 CYP2C19 (0.47) CNR2ALDH1A1KDM4ETDP1CYP2C19
SCHEMBL15682788 0.86 EGFR (0.42) EGFRERBB2CNR2ALDH1A1KDM4E
SCHEMBL17660036 0.86 EGFR (0.42) EGFRERBB2CNR2ALDH1A1KDM4E
SCHEMBL17660030 0.86 EGFR (0.42) EGFRERBB2CNR2ALDH1A1KDM4E
SCHEMBL21242480 0.86 CNR2 (0.48) EGFRERBB2CNR2ALDH1A1CYP2C19

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4370611-A1 COATING COMPOSITION Jotun A/S (NO) 2024-05-22 EP disclosed
WO-2023285527-A1 COATING COMPOSITION JOTUN A/S (NO) 2023-01-19 WO disclosed
US-20220049039-A1 RADICAL POLYMERIZABLE RESIN COMPOSITION AND STRUCTURE REPAIRING MATERIAL SHOWA DENKO K.K. (JP) 2022-02-17 US disclosed
US-20210283655-A1 STRUCTURE REPAIRING METHOD SHOWA DENKO K.K. (JP) 2021-09-16 US disclosed
EP-3858805-A1 STRUCTURE REPAIRING METHOD Showa Denko K.K. (JP) 2021-08-04 EP disclosed
EP-3858880-A1 RADICAL POLYMERIZABLE RESIN COMPOSITION AND STRUCTURE REPAIRING MATERIAL Showa Denko K.K. (JP) 2021-08-04 EP disclosed
US-20210214471-A1 RADICALLY POLYMERIZABLE PUTTY-LIKE RESIN COMPOSITION, SEALING AGENT AND CRACK REPAIRING METHOD SHOWA DENKO K.K. (JP) 2021-07-15 US disclosed
WO-2020066363-A1 STRUCTURE REPAIRING METHOD 昭和電工株式会社 2020-04-02 WO disclosed
WO-2020066364-A1 RADICAL POLYMERIZABLE RESIN COMPOSITION AND STRUCTURE REPAIRING MATERIAL 昭和電工株式会社 2020-04-02 WO disclosed
US-20180002562-A1 LOW-TEMPERATURE-CURABLE CROSS-SECTION REPAIR MATERIAL, AND CROSS-SECTION REPAIRING METHOD USING THE SAME SHOWA DENKO K.K. (JP) 2018-01-04 US disclosed
EP-3260479-A1 LOW-TEMPERATURE-CURABLE CROSS-SECTION REPAIR MATERIAL, AND CROSS-SECTION REPAIR METHOD USING SAME Showa Denko K.K. (JP) 2017-12-27 EP disclosed
EP-2028202-B1 RADICAL POLYMERIZABLE RESIN COMPOSITION SHOWA DENKO KK (JP) 2012-10-31 EP disclosed
EP-2028202-A1 RADICAL POLYMERIZABLE RESIN COMPOSITION SHOWA HIGHPOLYMER CO., LTD. (JP) 2009-02-25 EP disclosed